TL;DR: Benzo(j)fluoranthen-4-ol (CAS 116610-84-5) is a chemical compound with molecular formula C20H12O and molecular weight 268.0888 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
pentacyclo[10.7.1.02,11.03,8.016,20]icosa-1(20),2(11),3,5,7,9,12,14,16,18-decaen-17-ol
Also Known As: benzo[j]fluoranthen-3-ol, Benzo(j)fluoranthen-4-ol, 4-hydroxybenzo
| Molecular Formula | C20H12O |
| Molecular Weight | 268.0888 g/mol |
| XLogP | 5.8 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 268.0888 Da |
| Heavy Atoms | 21 |
| Complexity | 405.0 |
| SMILES | C1=CC=C2C(=C1)C=CC3=C2C4=C5C3=CC=CC5=C(C=C4)O |
| InChIKey | OEAKGNRTXCFURY-UHFFFAOYSA-N |
The XLogP value of 5.8 indicates that Benzo(j)fluoranthen-4-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, Benzo(j)fluoranthen-4-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzo(j)fluoranthen-4-ol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Benzo(j)fluoranthen-4-ol is 116610-84-5.
The molecular formula of Benzo(j)fluoranthen-4-ol is C20H12O.
The molecular weight of Benzo(j)fluoranthen-4-ol is 268.0888 g/mol.
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